(2S)-2-[(5-chloranyl-1-methyl-indol-2-yl)carbonylamino]propanoic acid

Systemtic Name: (2S)-2-[(5-chloranyl-1-methyl-indol-2-yl)carbonylamino]propanoic acid Openeye Name: (2S)-2-[(5-chloro-1-methyl-indole-2-carbonyl)amino]propanoic acid CAS Name: (2S)-2-[[(5-chloro-1-methyl-2-indolyl)-oxomethyl]amino]propanoic acid IUPAC Name: (2S)-2-[(5-chloro-1-methylindole-2-carbonyl)amino]propanoic acid Traditional Name: (2S)-2-[(5-chloro-1-methyl-indole-2-carbonyl)amino]propionic acid Formula: C13H13ClN2O3 MolecularWeight: 280.70692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C1=CC2=C(N1C)C=CC(=C2)Cl

Isomeric SMILES

C[C@@H](C(=O)O)NC(=O)C1=CC2=C(N1C)C=CC(=C2)Cl

InChI

InChI=1S/C13H13ClN2O3/c1-7(13(18)19)15-12(17)11-6-8-5-9(14)3-4-10(8)16(11)2/h3-7H,1-2H3,(H,15,17)(H,18,19)/t7-/m0/s1